Vitas-M small molecule compound

2-{[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(diethylamino)phenyl]methylidene}acetohydrazide

Catalog ID
STK106324
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)N(CC)CC)nnc1c1ccc(cc1)OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C29H32N6O3S MW 544.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N6O3S/c1-5-34(6-2)23-11-7-21(8-12-23)19-30-31-27(36)20-39-29-33-32-28(22-9-15-25(37-3)16-10-22)35(29)24-13-17-26(38-4)18-14-24/h7-19H,5-6,20H2,1-4H3,(H,31,36)/b30-19+
InChIKey
CTGOHMMJABZBBB-NDZAJKAJSA-N
Synonyms
406464-30-0
(E)2((45bis(4methoxyphenyl)4H124triazol3yl)thio)N(4(diethylamino)benzylidene)acetohydrazide
2((45bis(4methoxyphenyl)124triazol3yl)sulfanyl)N((E)(4(diethylamino)phenyl)methylideneamino)acetamide
2((45BIS(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(4(DIETHYLAMINO)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
406464300
CCN(CC)C1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2)N(CC)CC)nnc1c1ccc(cc1)OC
InChI=1SC29H32N6O3Sc1534(62)2311721(81223)19303127(36)203929333228(2291525(373)161022)35(29)24131726(384)181424h719H5620H214H3(H3136)b3019+
MFCD03220710
ZINC000100872197
ZINC101509588

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Available files

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